Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7535763 | 1.00 | CYP2D6 (0.51) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL14616293 | 1.00 | CYP2D6 (0.51) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL374982 | 0.88 | CYP2D6 (0.49) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL22874083 | 0.88 | CYP2D6 (0.49) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL27535562 | 0.88 | CYP2D6 (0.47) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL5293383 | 0.87 | CYP2D6 (0.41) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL10580055 | 0.86 | CYP2D6 (0.48) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL4933681 | 0.86 | FAAH (0.53) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL375531 | 0.86 | FAAH (0.53) | CYP2D6CYP2C19GLO1ALDH1A1LMNA | |
| SCHEMBL24597077 | 0.85 | CYP2D6 (0.54) | CYP2D6CYP2C19GLO1ALDH1A1LMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113840540-A | Spice or flavouring mixtures | 西姆莱斯股份公司 | 2021-12-24 | — | — | CN | disclosed |
| CN-102596890-B | Esters as perfuming ingredients | FIRMENICH & CIE | 2014-12-17 | — | — | CN | disclosed |
| CN-102596890-A | Esters as perfuming ingredients | FIRMENICH & CIE | 2012-07-18 | — | — | CN | disclosed |
| WO-2011055251-A1 | ESTERS AS PERFUMING INGREDIENTS | FIRMENICH SA (CH) | 2011-05-12 | — | — | WO | disclosed |